(1-chloranylnaphthalen-2-yl) 2-(4-methylsulfonyl-2-nitro-phenyl)sulfanylethanoate

Systemtic Name: (1-chloranylnaphthalen-2-yl) 2-(4-methylsulfonyl-2-nitro-phenyl)sulfanylethanoate Openeye Name: (1-chloro-2-naphthyl) 2-(4-methylsulfonyl-2-nitro-phenyl)sulfanylacetate CAS Name: 2-[(4-methylsulfonyl-2-nitrophenyl)thio]acetic acid (1-chloro-2-naphthalenyl) ester IUPAC Name: (1-chloronaphthalen-2-yl) 2-(4-methylsulfonyl-2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-mesyl-2-nitro-phenyl)thio]acetic acid (1-chloro-2-naphthyl) ester Formula: C19H14ClNO6S2 MolecularWeight: 451.90056

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SCC(=O)OC2=C(C3=CC=CC=C3C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SCC(=O)OC2=C(C3=CC=CC=C3C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H14ClNO6S2/c1-29(25,26)13-7-9-17(15(10-13)21(23)24)28-11-18(22)27-16-8-6-12-4-2-3-5-14(12)19(16)20/h2-10H,11H2,1H3